Nonadecanoyl coenzyme a

Name: Nonadecanoyl coenzyme a
SKU: ACM25045618
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CAS

25045-61-8

Catalog Number

ACM25045618

Category

Other Products

Molecular Weight

1048.02

Molecular Formula

C₄₀H₇₂N₇O₁₇P₃S

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Specification

Synonyms

Nonadecanethioicacid,S-ester with coenzyme A (8CI); nonadecanoyl-coenzyme A; 3-phosphoadenosine 5-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(nonadecanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate); Coenzyme A,S-nonadecanoa

IUPAC Name

S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] nonadecanethioate

Canonical SMILES

CCCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O

InChI Key

YUJZGRUJMWKAJF-ZOUGCNRJSA-N

Exact Mass

1047.39000

H-Bond Acceptor

H-Bond Donor